UCSF

ZINC61360966

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2011 21 Yes

Popular Name: (1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1S)-1-(3-thienyl)ethyl]ethanamine (1S)-1-(2,7-dimethylpyrazolo[1,5…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.66 8.17 -51.39 2 4 1 47 301.439 4 ↓
Mid Mid (pH 6-8) 2.66 7.26 -8.95 1 4 0 42 300.431 4 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.